N-(tert-butylcarbamothioyl)-4-chloranyl-3-nitro-benzamide

Systemtic Name: N-(tert-butylcarbamothioyl)-4-chloranyl-3-nitro-benzamide Openeye Name: N-(tert-butylcarbamothioyl)-4-chloro-3-nitro-benzamide CAS Name: N-[(tert-butylamino)-sulfanylidenemethyl]-4-chloro-3-nitrobenzamide IUPAC Name: N-(tert-butylcarbamothioyl)-4-chloro-3-nitrobenzamide Traditional Name: N-(tert-butylthiocarbamoyl)-4-chloro-3-nitro-benzamide Formula: C12H14ClN3O3S MolecularWeight: 315.77586

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=S)NC(=O)C1=CC(=C(C=C1)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)NC(=S)NC(=O)C1=CC(=C(C=C1)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H14ClN3O3S/c1-12(2,3)15-11(20)14-10(17)7-4-5-8(13)9(6-7)16(18)19/h4-6H,1-3H3,(H2,14,15,17,20)